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Details

Stereochemistry ACHIRAL
Molecular Formula C6H12NO3P
Molecular Weight 177.1381
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Diethyl cyanomethylphosphonate

SMILES

CCOP(=O)(CC#N)OCC

InChI

InChIKey=KWMBADTWRIGGGG-UHFFFAOYSA-N
InChI=1S/C6H12NO3P/c1-3-9-11(8,6-5-7)10-4-2/h3-4,6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C6H12NO3P
Molecular Weight 177.1381
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 11:01:21 GMT 2025
Edited
by admin
on Wed Apr 02 11:01:21 GMT 2025
Record UNII
5S99GCU3PT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Diethyl cyanomethylphosphonate
Systematic Name English
Diethyl (cyanomethyl)phosphonate
Preferred Name English
NSC-407826
Code English
Diethyl cyanomethanephosphonate
Systematic Name English
Phosphonic acid, P-(cyanomethyl)-, diethyl ester
Systematic Name English
O,O-Diethyl (cyanomethyl)phosphonate
Systematic Name English
2-Diethoxyphosphorylacetonitrile
Systematic Name English
Diethyl P-(cyanomethyl)phosphonate
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID20180015
Created by admin on Wed Apr 02 11:01:21 GMT 2025 , Edited by admin on Wed Apr 02 11:01:21 GMT 2025
PRIMARY
ECHA (EC/EINECS)
219-806-0
Created by admin on Wed Apr 02 11:01:21 GMT 2025 , Edited by admin on Wed Apr 02 11:01:21 GMT 2025
PRIMARY
PUBCHEM
75676
Created by admin on Wed Apr 02 11:01:21 GMT 2025 , Edited by admin on Wed Apr 02 11:01:21 GMT 2025
PRIMARY
FDA UNII
5S99GCU3PT
Created by admin on Wed Apr 02 11:01:21 GMT 2025 , Edited by admin on Wed Apr 02 11:01:21 GMT 2025
PRIMARY
CAS
2537-48-6
Created by admin on Wed Apr 02 11:01:21 GMT 2025 , Edited by admin on Wed Apr 02 11:01:21 GMT 2025
PRIMARY
NSC
407826
Created by admin on Wed Apr 02 11:01:21 GMT 2025 , Edited by admin on Wed Apr 02 11:01:21 GMT 2025
PRIMARY